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{
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"results": [
{
"id": "mp-1094186",
"created_at": "2022-09-04T14:44:42.316254Z",
"structure_string": "La1 Mg5\n1.0\n1.613445 6.515280 0.000000\n-1.613445 6.515280 0.000000\n0.000000 1.950476 7.410381\nLa Mg\n1 5\ndirect\n0.613165 0.613165 0.270957 La\n0.990136 0.990136 0.991910 Mg\n0.337704 0.337704 0.338933 Mg\n0.936954 0.936954 0.620838 Mg\n0.667270 0.667270 0.677548 Mg\n0.288104 0.288104 0.933147 Mg\n",
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{
"id": "mp-1211590",
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"structure_string": "La5 Mg41\n1.0\n-7.397314 7.397314 5.236096\n7.397314 -7.397314 5.236096\n7.397314 7.397314 -5.236096\nLa Mg\n5 41\ndirect\n0.000000 0.000000 0.000000 La\n0.570970 0.236878 0.807849 La\n0.429030 0.763122 0.192151 La\n0.236878 0.429030 0.665908 La\n0.763122 0.570970 0.334092 La\n0.778614 0.121895 0.900508 Mg\n0.221386 0.878105 0.099492 Mg\n0.121895 0.221386 0.343281 Mg\n0.878105 0.778614 0.656719 Mg\n0.791855 0.080007 0.165849 Mg\n0.208145 0.919993 0.834151 Mg\n0.914158 0.626006 0.834151 Mg\n0.080007 0.914158 0.288152 Mg\n0.085842 0.373994 0.165849 Mg\n0.919993 0.085842 0.711848 Mg\n0.626006 0.791855 0.711848 Mg\n0.373994 0.208145 0.288152 Mg\n0.989966 0.402439 0.392406 Mg\n0.010034 0.597561 0.607594 Mg\n0.402439 0.010034 0.412473 Mg\n0.597561 0.989966 0.587527 Mg\n0.554310 0.767175 0.940674 Mg\n0.445690 0.232825 0.059326 Mg\n0.826500 0.613636 0.059326 Mg\n0.767175 0.826500 0.212865 Mg\n0.173500 0.386364 0.940674 Mg\n0.232825 0.173500 0.787135 Mg\n0.613636 0.554310 0.787135 Mg\n0.386364 0.445690 0.212865 Mg\n0.783260 0.341012 0.124272 Mg\n0.216740 0.658988 0.875728 Mg\n0.341012 0.216740 0.557752 Mg\n0.658988 0.783260 0.442248 Mg\n0.374055 0.817706 0.709484 Mg\n0.625945 0.182294 0.290516 Mg\n0.108221 0.664570 0.290516 Mg\n0.817706 0.108221 0.443651 Mg\n0.891779 0.335430 0.709484 Mg\n0.182294 0.891779 0.556349 Mg\n0.664570 0.374055 0.556349 Mg\n0.335430 0.625945 0.443651 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n",
"nsites": 46,
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"elements": [
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"density": 2.450108481344692,
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"volume": 1146.0820210369939,
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"formula_full": "La5 Mg41",
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"updated_at": "2021-11-28T01:36:47.838000Z",
"spacegroup": 87
},
{
"id": "mp-1094182",
"created_at": "2022-09-04T14:47:07.893151Z",
"structure_string": "La3 Mg3\n1.0\n1.782623 6.470679 0.000000\n-1.782623 6.470679 0.000000\n0.000000 2.372940 7.767297\nLa Mg\n3 3\ndirect\n0.999665 0.999665 0.014763 La\n0.627229 0.627229 0.258012 La\n0.645604 0.645604 0.684444 La\n0.335728 0.335728 0.352296 Mg\n0.930473 0.930473 0.606026 Mg\n0.294633 0.294633 0.917792 Mg\n",
"nsites": 6,
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"elements": [
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"density": 4.537421232027856,
"density_atomic": 0.03348435839456537,
"volume": 179.18814299197743,
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"formula_full": "La3 Mg3",
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"energy": -19.72816818,
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"updated_at": "2021-11-28T01:37:58.626000Z",
"spacegroup": 8
},
{
"id": "mp-1094170",
"created_at": "2022-09-04T14:45:57.325881Z",
"structure_string": "La4 Mg2\n1.0\n1.822670 -9.274204 0.000000\n1.822670 9.274204 0.000000\n0.000000 0.000000 5.749656\nLa Mg\n4 2\ndirect\n0.444450 0.555550 0.250000 La\n0.775149 0.224851 0.250000 La\n0.224851 0.775149 0.750000 La\n0.555550 0.444450 0.750000 La\n0.111123 0.888877 0.250000 Mg\n0.888877 0.111123 0.750000 Mg\n",
"nsites": 6,
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"elements": [
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"chemical_system": "La-Mg",
"density": 5.161740717200402,
"density_atomic": 0.03086701996890305,
"volume": 194.38222433019754,
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"formula_full": "La4 Mg2",
"formula_reduced": "La2Mg",
"formula_anonymous": "AB2",
"energy": -22.81092744,
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"updated_at": "2021-11-28T01:37:08.657000Z",
"spacegroup": 63
},
{
"id": "mp-1094161",
"created_at": "2022-09-04T14:46:01.837607Z",
"structure_string": "La2 Mg4\n1.0\n3.041813 -5.268575 0.000000\n3.041813 5.268575 0.000000\n0.000000 0.000000 5.354196\nLa Mg\n2 4\ndirect\n0.666667 0.333333 0.500000 La\n0.333333 0.666667 0.500000 La\n0.000000 0.699716 0.000000 Mg\n0.699716 0.000000 0.000000 Mg\n0.300284 0.300284 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n",
"nsites": 6,
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"elements": [
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"density": 3.628826936027049,
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"volume": 171.6129035725055,
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"formula_full": "La2 Mg4",
"formula_reduced": "LaMg2",
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"updated_at": "2021-11-28T01:37:17.386000Z",
"spacegroup": 189
},
{
"id": "mp-1104815",
"created_at": "2022-09-04T14:46:01.351914Z",
"structure_string": "La1 Mg12\n1.0\n-5.182065 5.182065 2.968053\n5.182065 -5.182065 2.968053\n5.182065 5.182065 -2.968053\nLa Mg\n1 12\ndirect\n0.000000 0.000000 0.000000 La\n0.000000 0.000000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.352625 0.352625 Mg\n0.000000 0.647375 0.647375 Mg\n0.647375 0.000000 0.647375 Mg\n0.352625 0.000000 0.352625 Mg\n0.500000 0.281946 0.781946 Mg\n0.500000 0.718054 0.218054 Mg\n0.718054 0.500000 0.218054 Mg\n0.281946 0.500000 0.781946 Mg\n",
"nsites": 13,
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"volume": 318.81397887478397,
"volume_molar": 14.768789669535504,
"formula_full": "La1 Mg12",
"formula_reduced": "LaMg12",
"formula_anonymous": "AB12",
"energy": -24.76542196,
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"spacegroup": 139
},
{
"id": "mp-1094174",
"created_at": "2022-09-04T14:45:58.484912Z",
"structure_string": "La1 Mg3\n1.0\n-2.687977 2.687977 3.635109\n2.687977 -2.687977 3.635109\n2.687977 2.687977 -3.635109\nLa Mg\n1 3\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.000000 Mg\n0.250000 0.750000 0.500000 Mg\n0.750000 0.250000 0.500000 Mg\n",
"nsites": 4,
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"volume": 105.05785412184535,
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"formula_full": "La1 Mg3",
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"spacegroup": 139
},
{
"id": "mp-1094176",
"created_at": "2022-09-04T14:42:51.044078Z",
"structure_string": "La2 Mg4\n1.0\n1.717279 6.210483 0.000000\n-1.717279 6.210483 0.000000\n0.000000 2.009441 7.822708\nLa Mg\n2 4\ndirect\n0.643335 0.643335 0.454504 La\n0.356665 0.356665 0.545496 La\n0.315166 0.315166 0.114245 Mg\n0.022070 0.022070 0.180399 Mg\n0.977930 0.977930 0.819601 Mg\n0.684834 0.684834 0.885755 Mg\n",
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{
"id": "mp-30752",
"created_at": "2022-09-04T14:42:27.827977Z",
"structure_string": "La4 Mg34\n1.0\n5.179725 -8.971547 0.000000\n5.179725 8.971547 0.000000\n0.000000 0.000000 10.175870\nLa Mg\n4 34\ndirect\n0.666667 0.333333 0.250000 La\n0.333333 0.666667 0.750000 La\n0.000000 0.000000 0.750000 La\n0.000000 0.000000 0.250000 La\n0.162349 0.837651 0.521343 Mg\n0.162349 0.324697 0.521343 Mg\n0.675303 0.837651 0.521343 Mg\n0.324697 0.162349 0.021343 Mg\n0.333333 0.666667 0.100947 Mg\n0.666667 0.333333 0.600947 Mg\n0.666667 0.333333 0.899053 Mg\n0.333333 0.666667 0.399053 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.328403 0.964349 0.250000 Mg\n0.364054 0.328403 0.750000 Mg\n0.964349 0.635946 0.750000 Mg\n0.035651 0.364054 0.250000 Mg\n0.635946 0.671597 0.250000 Mg\n0.364054 0.035651 0.750000 Mg\n0.671597 0.635946 0.750000 Mg\n0.671597 0.035651 0.750000 Mg\n0.964349 0.328403 0.750000 Mg\n0.035651 0.671597 0.250000 Mg\n0.635946 0.964349 0.250000 Mg\n0.328403 0.364054 0.250000 Mg\n0.162349 0.324697 0.978657 Mg\n0.837651 0.162349 0.478657 Mg\n0.324697 0.162349 0.478657 Mg\n0.675303 0.837651 0.978657 Mg\n0.162349 0.837651 0.978657 Mg\n0.837651 0.675303 0.021343 Mg\n0.837651 0.162349 0.021343 Mg\n0.837651 0.675303 0.478657 Mg\n",
"nsites": 38,
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"elements": [
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"formula_full": "La4 Mg34",
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"spacegroup": 194
},
{
"id": "mp-1094190",
"created_at": "2022-09-04T14:41:49.702635Z",
"structure_string": "La4 Mg2\n1.0\n1.870609 6.240060 0.000000\n-1.870609 6.240060 0.000000\n0.000000 3.114708 8.355228\nLa Mg\n4 2\ndirect\n0.329211 0.329211 0.119028 La\n0.018911 0.018911 0.257688 La\n0.981089 0.981089 0.742312 La\n0.670789 0.670789 0.880972 La\n0.672876 0.672876 0.449296 Mg\n0.327124 0.327124 0.550704 Mg\n",
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"formula_full": "La4 Mg2",
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{
"id": "mp-1185098",
"created_at": "2022-09-04T14:40:36.569111Z",
"structure_string": "La5 Mg1\n1.0\n1.865142 -9.423437 0.000000\n1.865142 9.423437 0.000000\n0.000000 0.000000 5.968594\nLa Mg\n5 1\ndirect\n0.994547 0.005453 0.000000 La\n0.326587 0.673413 0.000000 La\n0.667689 0.332311 0.000000 La\n0.443423 0.556577 0.500000 La\n0.121612 0.878388 0.500000 La\n0.779480 0.220520 0.500000 Mg\n",
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"spacegroup": 38
},
{
"id": "mp-1023560",
"created_at": "2022-09-04T14:45:42.477918Z",
"structure_string": "La1 Mg15\n1.0\n3.297088 -5.710723 0.000000\n3.297088 5.710723 0.000000\n0.000000 0.000000 10.359722\nLa Mg\n1 15\ndirect\n0.000000 0.000000 0.500000 La\n0.000000 0.000000 0.000000 Mg\n0.010948 0.505474 0.500000 Mg\n0.998099 0.499050 0.000000 Mg\n0.494526 0.505474 0.500000 Mg\n0.500950 0.499050 0.000000 Mg\n0.494526 0.989052 0.500000 Mg\n0.500950 0.001901 0.000000 Mg\n0.168245 0.336490 0.244039 Mg\n0.168245 0.336490 0.755961 Mg\n0.168245 0.831755 0.244039 Mg\n0.168245 0.831755 0.755961 Mg\n0.663510 0.831755 0.244039 Mg\n0.663510 0.831755 0.755961 Mg\n0.666667 0.333333 0.254970 Mg\n0.666667 0.333333 0.745030 Mg\n",
"nsites": 16,
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"elements": [
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],
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"density": 2.1430484787783035,
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"volume": 390.1213612217205,
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"formula_full": "La1 Mg15",
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"spacegroup": 187
}
]
}